Name: Name:10,14-dioxa-4-thia-6-azatricyclo[7.5.0.0,3,7]tetradeca-1(9),2,5,7-tetraen-5-amine
Brand: Angene
SKU: AG019M1N
Rating: 90 (10 reviews)

10,14-dioxa-4-thia-6-azatricyclo[7.5.0.0,3,7]tetradeca-1(9),2,5,7-tetraen-5-amine

CAS No.:

885461-34-7

Catalog Number:

AG019M1N

Molecular Formula:

C10H10N2O2S

Molecular Weight:

222.2636

Catalog Number:

AG019M1N

Chemical Name:

10,14-dioxa-4-thia-6-azatricyclo[7.5.0.0,3,7]tetradeca-1(9),2,5,7-tetraen-5-amine

CAS Number:

885461-34-7

Molecular Formula:

C10H10N2O2S

Molecular Weight:

222.2636

MDL Number:

MFCD06660788

IUPAC Name:

7,8-dihydro-6H-[1,4]dioxepino[2,3-f][1,3]benzothiazol-2-amine

InChI:

InChI=1S/C10H10N2O2S/c11-10-12-6-4-7-8(5-9(6)15-10)14-3-1-2-13-7/h4-5H,1-3H2,(H2,11,12)

InChI Key:

XZTYDDXBQFZSDM-UHFFFAOYSA-N

SMILES:

Nc1nc2c(s1)cc1c(c2)OCCCO1

Complexity:

242

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

222.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

222.262g/mol

Monoisotopic Mass:

222.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

85.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1